(3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone

C11H16N2OS — CID 84577036

IUPAC(3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone
SMILESCc1cc(C(=O)N2CCCC(C)C2)ns1
InChIInChI=1S/C11H16N2OS/c1-8-4-3-5-13(7-8)11(14)10-6-9(2)15-12-10/h6,8H,3-5,7H2,1-2H3
InChIKeyNDRJNSUKAGLXTQ-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.32
Rot. Bonds1

About (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone

(3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone (PubChem CID 84577036) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone.

Molecular Properties

Compound Name(3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone
PubChem CID84577036
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name(3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone
SMILESCc1cc(C(=O)N2CCCC(C)C2)ns1
InChIInChI=1S/C11H16N2OS/c1-8-4-3-5-13(7-8)11(14)10-6-9(2)15-12-10/h6,8H,3-5,7H2,1-2H3
InChIKeyNDRJNSUKAGLXTQ-UHFFFAOYSA-N
XLogP2.32
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methyl-1,2-thiazol-3-yl)-morpholin-4-ylmethanone
CID 84576851
(3-methylpiperidin-1-yl)-(6-methyl-2-pyrrolidin-1-ylpyrimidin-4-yl)methanone
CID 109321612
[1-methyl-3-[(3S)-3-methylpiperidine-1-carbonyl]pyrazol-5-yl]-[(3R)-3-methylpiperidin-1-yl]methanone
CID 29097980
(5-tert-butyl-1H-pyrazol-3-yl)-(3-methylpiperidin-1-yl)methanone
CID 110856017
[6-(3-methylpiperidine-1-carbonyl)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109095169
[5-methyl-1-(4-methylphenyl)pyrazol-3-yl]-(3-methylpiperidin-1-yl)methanone
CID 110372815
[2-(cyclopropylamino)-6-methylpyrimidin-4-yl]-(3-methylpiperidin-1-yl)methanone
CID 109319726
(3-methylpiperidin-1-yl)-(4-pyrrolidin-1-yl-2-pyridinyl)methanone
CID 109203878
4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 112700608
[3-(4-methylphenyl)-1,2-oxazol-5-yl]-(3-methylpiperidin-1-yl)methanone
CID 86980129
(3-methylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 3113385
(2,5-dimethyl-1,3-thiazol-4-yl)-(3-methylpiperidin-1-yl)methanone
CID 110465501

Frequently Asked Questions

What is the IUPAC name of (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone?
The IUPAC name of (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone (CID 84577036) is (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone.
What is the SMILES notation for (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone?
The canonical SMILES for (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone is Cc1cc(C(=O)N2CCCC(C)C2)ns1.
What is the InChIKey of (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone?
The InChIKey is NDRJNSUKAGLXTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-8-4-3-5-13(7-8)11(14)10-6-9(2)15-12-10/h6,8H,3-5,7H2,1-2H3.
What are the key properties of (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone?
(3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone has a molecular weight of 224.33 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylpiperidin-1-yl)-(5-methyl-1,2-thiazol-3-yl)methanone is sourced from PubChem (CID 84577036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).